Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C30H38O9S/c1-5-40-30-29(37-21(3)32)28(36-18-22-9-7-6-8-10-22)27(39-26(33)16-11-20(2)31)25(38-30)19-35-17-23-12-14-24(34-4)15-13-23/h6-10,12-15,25,27-30H,5,11,16-19H2,1-4H3/t25-,27-,28+,29-,30+/m1/s1 |
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SMILES | CCS[C@@H]1O[C@H](COCc2ccc(cc2)OC)[C@H]([C@@H]([C@H]1OC(=O)C)OCc1ccccc1)OC(=O)CCC(=O)C |
InChI Key | HCFDSKUYXTUZNC-TWZZTNFBSA-N |
Molecular Formula | C30H38O9S |
Exact Mass | 574.682 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/HCFDSKUYXTUZNC-TWZZTNFBSA-N/DEPT/90 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/HCFDSKUYXTUZNC-TWZZTNFBSA-N/DEPT/90 |
Version | |
Author | Benjamin Goerling |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T23:23:54.160665 |
MetadataModified | 2024-09-07T12:32:08.307405 |
MetadataPublished | 2014-05-27 |
Field | Value |
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Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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73427308 | PubChem |
The data in this table is sourced from UniChem at EBI. |